==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JUL-06 2IZO . COMPND 2 MOLECULE: FLAP STRUCTURE-SPECIFIC ENDONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR A.S.DORE,M.L.KILKENNY,S.M.ROE,L.H.PEARL . 756 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 553 73.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 21 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 222 29.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 60 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 160 21.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 1 1 1 3 2 3 1 1 0 3 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 6 2 4 5 8 7 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 0 1 0 0 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 181 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 149.0 -18.6 -43.7 4.6 2 2 A D + 0 0 63 1,-0.1 2,-0.3 184,-0.1 172,-0.1 0.553 360.0 16.2-126.0 -39.7 -21.1 -41.9 6.8 3 3 A L + 0 0 9 170,-0.1 -1,-0.1 1,-0.0 3,-0.0 -0.829 62.5 139.5-137.1 104.9 -22.5 -39.4 4.3 4 4 A V + 0 0 77 -2,-0.3 -1,-0.0 -3,-0.1 184,-0.0 -0.350 46.5 106.3-127.2 44.4 -22.0 -40.1 0.6 5 5 A K + 0 0 20 182,-0.0 2,-0.4 2,-0.0 154,-0.1 -0.419 63.1 116.3-109.1 46.5 -25.5 -39.0 -0.2 6 6 A D + 0 0 29 2,-0.1 2,-0.5 153,-0.0 149,-0.0 -0.979 44.0 175.0-130.5 124.6 -23.9 -35.9 -1.7 7 7 A V + 0 0 104 -2,-0.4 2,-0.3 2,-0.0 151,-0.1 -0.994 38.5 163.0-108.2 115.7 -23.6 -34.2 -5.0 8 8 A K - 0 0 103 -2,-0.5 2,-0.3 142,-0.1 142,-0.2 -0.954 31.0-129.8-137.1 148.3 -21.8 -31.0 -3.8 9 9 A R E -A 149 0A 132 140,-0.8 140,-2.6 -2,-0.3 2,-0.1 -0.737 18.1-121.2-105.0 149.9 -19.8 -28.3 -5.5 10 10 A E E -A 148 0A 118 -2,-0.3 2,-0.4 138,-0.2 138,-0.3 -0.470 26.7-147.2 -78.2 158.2 -16.4 -26.9 -4.7 11 11 A L - 0 0 6 136,-1.7 2,-0.1 -2,-0.1 -1,-0.0 -0.997 7.9-128.5-132.9 137.5 -16.1 -23.2 -4.0 12 12 A S >> - 0 0 61 -2,-0.4 4,-0.9 1,-0.1 3,-0.7 -0.414 29.8-114.3 -72.4 154.9 -13.3 -20.7 -4.7 13 13 A F H 3> S+ 0 0 68 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.691 113.0 74.6 -63.4 -18.9 -12.0 -18.6 -1.9 14 14 A S H >4 S+ 0 0 54 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.943 99.0 41.0 -54.8 -52.2 -13.4 -15.7 -4.0 15 15 A E H <4 S+ 0 0 31 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.739 115.6 52.7 -70.2 -22.7 -17.0 -16.6 -3.1 16 16 A L H >< S+ 0 0 0 -4,-0.9 3,-1.0 50,-0.1 -1,-0.2 0.578 82.0 116.9 -90.6 -11.5 -15.9 -17.3 0.5 17 17 A K T << S+ 0 0 73 -4,-1.0 50,-0.2 -3,-0.7 51,-0.2 -0.359 78.7 17.7 -62.2 130.3 -14.2 -13.9 0.9 18 18 A G T 3 S+ 0 0 20 49,-1.7 2,-0.4 1,-0.2 -1,-0.2 0.775 97.5 131.9 79.2 30.6 -15.8 -11.7 3.6 19 19 A K E < -b 68 0A 52 -3,-1.0 50,-2.0 48,-0.6 2,-0.3 -0.954 54.8-135.0-125.3 129.7 -17.6 -14.5 5.3 20 20 A R E -b 69 0A 57 -2,-0.4 97,-3.3 48,-0.2 98,-0.8 -0.632 27.1-162.1 -75.8 131.7 -17.8 -15.6 9.0 21 21 A V E -bc 70 118A 0 48,-2.8 50,-2.5 -2,-0.3 2,-1.4 -0.975 18.9-139.9-126.7 127.6 -17.4 -19.3 9.4 22 22 A S E -bc 71 119A 0 96,-2.9 98,-2.5 -2,-0.4 2,-0.3 -0.641 29.4-172.0 -84.0 83.3 -18.3 -21.5 12.3 23 23 A I E -bc 72 120A 3 48,-2.0 50,-2.1 -2,-1.4 2,-0.4 -0.585 25.3-120.9 -77.4 133.7 -15.3 -23.8 12.5 24 24 A D E > -b 73 0A 10 96,-2.3 4,-2.0 -2,-0.3 50,-0.2 -0.656 17.8-151.6 -73.1 126.2 -15.5 -26.8 15.0 25 25 A G H > S+ 0 0 0 48,-3.0 4,-2.4 -2,-0.4 49,-0.2 0.978 91.5 43.9 -61.1 -59.7 -12.7 -26.4 17.5 26 26 A Y H > S+ 0 0 59 47,-0.6 4,-2.2 1,-0.2 5,-0.2 0.900 115.0 48.2 -56.7 -48.8 -12.3 -30.1 18.3 27 27 A N H > S+ 0 0 11 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.916 112.1 50.2 -57.6 -46.6 -12.5 -31.3 14.6 28 28 A A H X S+ 0 0 1 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.905 109.9 50.9 -56.4 -46.3 -10.0 -28.6 13.6 29 29 A L H X S+ 0 0 11 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.926 108.7 48.7 -63.3 -51.1 -7.5 -29.6 16.3 30 30 A Y H X S+ 0 0 154 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.914 110.0 54.2 -53.2 -45.8 -7.5 -33.4 15.5 31 31 A Q H X S+ 0 0 50 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.909 111.4 44.2 -55.4 -44.8 -7.0 -32.5 11.8 32 32 A F H < S+ 0 0 5 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.775 113.8 51.1 -71.1 -28.6 -3.9 -30.4 12.8 33 33 A L H < S+ 0 0 46 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.773 116.5 40.6 -76.4 -27.7 -2.8 -33.2 15.1 34 34 A A H < S+ 0 0 70 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.578 118.5 45.3 -96.3 -12.7 -3.2 -35.8 12.3 35 35 A A S < S+ 0 0 55 -4,-1.2 2,-0.3 -5,-0.2 -3,-0.2 0.895 93.6 52.6 -96.7 -84.3 -1.8 -33.7 9.4 36 36 A I + 0 0 84 -4,-0.3 6,-0.5 -5,-0.2 2,-0.4 -0.428 51.7 163.3 -74.7 123.1 1.4 -31.6 9.7 37 37 A R - 0 0 132 -2,-0.3 -4,-0.0 4,-0.1 -1,-0.0 -0.929 16.9-169.4-140.8 110.6 4.5 -33.4 11.0 38 38 A Q 0 0 80 -2,-0.4 -1,-0.1 1,-0.0 4,-0.1 0.939 360.0 360.0 -71.8 -52.7 8.0 -31.8 10.4 39 39 A P 0 0 147 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.895 360.0 360.0 -95.2 360.0 10.4 -34.6 11.4 40 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 41 43 A P 0 0 80 0, 0.0 2,-0.5 0, 0.0 -4,-0.1 0.000 360.0 360.0 360.0 138.8 4.0 -35.5 16.0 42 44 A L - 0 0 41 -6,-0.5 8,-3.5 -9,-0.1 9,-0.8 -0.536 360.0-169.9 -71.6 117.9 5.7 -32.0 16.2 43 45 A M B -G 49 0B 100 -2,-0.5 2,-0.2 6,-0.2 6,-0.2 -0.390 11.0-150.9-104.7 176.7 7.6 -31.8 19.5 44 46 A D - 0 0 22 4,-0.6 3,-0.1 -2,-0.1 196,-0.1 -0.576 41.4 -76.9-130.8-164.0 9.3 -29.1 21.6 45 47 A S S S+ 0 0 88 1,-0.2 194,-0.1 -2,-0.2 193,-0.1 0.887 126.3 48.0 -68.0 -42.6 12.2 -28.7 24.1 46 48 A Q S S- 0 0 139 192,-0.2 -1,-0.2 2,-0.1 193,-0.1 0.648 120.7-106.0 -76.1 -15.9 10.2 -30.0 27.1 47 49 A G S S+ 0 0 42 1,-0.3 2,-0.3 -3,-0.1 -2,-0.1 0.895 75.0 122.5 91.8 48.7 9.1 -33.0 25.1 48 50 A R - 0 0 134 191,-0.0 -4,-0.6 -6,-0.0 2,-0.3 -0.925 67.9 -87.5-134.7 161.0 5.4 -32.4 24.3 49 51 A V B +G 43 0B 48 -2,-0.3 -6,-0.2 -6,-0.2 4,-0.1 -0.526 38.9 168.4 -71.0 125.8 3.2 -32.1 21.2 50 52 A T >> + 0 0 14 -8,-3.5 4,-1.5 -2,-0.3 3,-0.7 0.245 50.0 104.0-115.5 7.7 3.2 -28.5 19.8 51 53 A S H 3> S+ 0 0 2 -9,-0.8 4,-1.3 1,-0.2 -15,-0.1 0.772 72.8 60.7 -64.3 -30.4 1.5 -29.6 16.5 52 54 A H H 3> S+ 0 0 5 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.875 105.5 48.3 -62.9 -38.0 -1.9 -28.2 17.5 53 55 A L H <> S+ 0 0 0 -3,-0.7 4,-2.1 2,-0.2 5,-0.2 0.875 104.0 59.1 -71.5 -40.3 -0.4 -24.7 17.8 54 56 A S H X S+ 0 0 31 -4,-1.5 4,-2.2 2,-0.2 5,-0.4 0.861 110.2 44.5 -56.4 -39.2 1.3 -24.9 14.4 55 57 A G H X>S+ 0 0 1 -4,-1.3 4,-2.0 2,-0.2 5,-0.9 0.966 111.9 49.8 -68.0 -55.6 -2.1 -25.4 12.8 56 58 A L H <5S+ 0 0 0 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.753 121.3 37.2 -55.2 -29.7 -3.9 -22.7 14.8 57 59 A F H X5S+ 0 0 6 -4,-2.1 4,-1.5 3,-0.1 -2,-0.2 0.942 124.4 32.8 -86.8 -63.5 -1.2 -20.2 13.9 58 60 A Y H X5S+ 0 0 80 -4,-2.2 4,-1.5 -5,-0.2 -3,-0.2 0.869 123.6 42.0 -66.4 -43.4 -0.1 -21.0 10.3 59 61 A R H X5S+ 0 0 16 -4,-2.0 4,-1.9 -5,-0.4 -1,-0.2 0.809 110.3 55.8 -77.6 -32.0 -3.5 -22.2 8.9 60 62 A T H >X>S+ 0 0 7 -4,-1.9 5,-1.7 2,-0.2 3,-0.6 0.922 114.4 45.2 -66.6 -49.0 -7.6 -18.5 6.3 64 66 A L H ><5S+ 0 0 1 -4,-2.7 3,-0.7 1,-0.2 -2,-0.2 0.814 106.4 59.3 -67.6 -34.3 -7.7 -14.8 7.2 65 67 A E H 3<5S+ 0 0 69 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.721 104.7 52.4 -67.6 -21.1 -5.5 -13.8 4.3 66 68 A E H <<5S- 0 0 86 -3,-0.6 -1,-0.2 -4,-0.5 -2,-0.2 0.612 125.2-102.8 -89.3 -15.5 -8.1 -15.2 2.0 67 69 A G T <<5S+ 0 0 4 -3,-0.7 -49,-1.7 -4,-0.5 -48,-0.6 0.364 75.5 134.4 112.5 -1.7 -10.9 -13.2 3.6 68 70 A V E < -b 19 0A 0 -5,-1.7 -1,-0.3 -50,-0.2 -48,-0.2 -0.678 48.0-144.5 -81.9 124.6 -12.6 -15.8 5.8 69 71 A I E -b 20 0A 2 -50,-2.0 -48,-2.8 -2,-0.5 2,-0.4 -0.832 24.3-146.1 -87.2 114.1 -13.4 -14.6 9.4 70 72 A P E -b 21 0A 0 0, 0.0 2,-0.5 0, 0.0 -48,-0.2 -0.666 18.6-172.5 -90.5 132.8 -12.9 -17.7 11.5 71 73 A I E -b 22 0A 0 -50,-2.5 -48,-2.0 -2,-0.4 2,-0.4 -0.976 12.0-154.9-120.7 114.9 -14.9 -18.6 14.6 72 74 A Y E -bd 23 96A 0 23,-1.4 25,-1.9 -2,-0.5 2,-0.5 -0.765 7.7-158.2 -88.6 131.4 -13.6 -21.6 16.5 73 75 A V E -bd 24 97A 0 -50,-2.1 -48,-3.0 -2,-0.4 -47,-0.6 -0.949 8.9-173.5-117.1 118.1 -16.3 -23.4 18.6 74 76 A F E + d 0 98A 0 23,-1.8 25,-3.7 -2,-0.5 27,-0.1 -0.753 10.1 173.8-106.2 155.0 -15.3 -25.6 21.6 75 77 A D 0 0 32 -2,-0.3 -1,-0.1 23,-0.2 27,-0.1 0.699 360.0 360.0-123.7 -61.1 -17.6 -27.8 23.7 76 78 A G 0 0 90 25,-0.0 26,-0.1 22,-0.0 25,-0.1 -0.405 360.0 360.0 96.5 360.0 -15.9 -30.0 26.4 77 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 78 125 A S > 0 0 118 0, 0.0 4,-1.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 142.6 -5.9 -33.5 26.9 79 126 A N H > + 0 0 83 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.721 360.0 59.4 -71.3 -23.2 -8.2 -30.7 28.2 80 127 A I H > S+ 0 0 120 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.840 99.8 55.7 -72.7 -36.5 -5.1 -28.5 28.7 81 128 A M H 4 S+ 0 0 53 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.872 110.2 46.5 -60.4 -39.7 -4.2 -28.8 25.0 82 129 A V H X S+ 0 0 18 -4,-1.1 4,-1.8 2,-0.2 3,-0.4 0.908 113.6 48.3 -67.0 -44.9 -7.7 -27.4 24.3 83 130 A E H X S+ 0 0 87 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.889 111.2 48.4 -65.3 -41.9 -7.3 -24.7 26.9 84 131 A E H < S+ 0 0 26 -4,-3.1 4,-0.4 1,-0.2 -1,-0.2 0.564 109.1 55.9 -78.6 -7.9 -3.8 -23.6 25.6 85 132 A S H > S+ 0 0 1 -4,-0.4 4,-1.7 -3,-0.4 -2,-0.2 0.817 109.6 45.6 -80.7 -39.5 -5.4 -23.6 22.1 86 133 A K H X S+ 0 0 30 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.931 107.9 55.6 -65.9 -49.5 -8.1 -21.2 23.4 87 134 A K H X S+ 0 0 89 -4,-2.6 4,-1.3 1,-0.2 -1,-0.2 0.785 109.1 49.7 -55.7 -31.2 -5.5 -19.0 25.2 88 135 A L H > S+ 0 0 0 -4,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.912 109.8 49.2 -71.3 -46.2 -3.7 -18.7 21.8 89 136 A L H X>S+ 0 0 0 -4,-1.7 4,-0.9 2,-0.2 5,-0.6 0.815 111.2 49.9 -66.4 -32.4 -6.9 -17.7 20.0 90 137 A R H <5S+ 0 0 154 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.888 112.7 47.8 -66.2 -41.6 -7.7 -15.1 22.6 91 138 A A H <5S+ 0 0 5 -4,-1.3 136,-1.0 -5,-0.3 -2,-0.2 0.717 111.4 49.8 -73.7 -24.5 -4.2 -13.7 22.2 92 139 A M H <5S- 0 0 0 -4,-1.7 -1,-0.2 134,-0.2 -2,-0.2 0.680 111.0-125.8 -82.0 -22.5 -4.6 -13.8 18.4 93 140 A G T <5 + 0 0 9 -4,-0.9 131,-1.6 1,-0.3 -3,-0.2 0.224 60.1 144.7 96.3 -11.5 -7.9 -11.9 18.8 94 141 A I < - 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